[4-(3,5-dimethoxyphenoxy)-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-azanium

Systemtic Name: [4-(3,5-dimethoxyphenoxy)-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-azanium Openeye Name: [4-(3,5-dimethoxyphenoxy)-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-ammonium CAS Name: [4-(3,5-dimethoxyphenoxy)-5,6-dimethyl-2-thieno[2,3-d]pyrimidinyl]methyl-diethylammonium IUPAC Name: [4-(3,5-dimethoxyphenoxy)-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl]methyl-diethylazanium Traditional Name: [4-(3,5-dimethoxyphenoxy)-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl]methyl-diethyl-ammonium Formula: C21H28N3O3S+ MolecularWeight: 402.53032

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=NC(=C2C(=C(SC2=N1)C)C)OC3=CC(=CC(=C3)OC)OC

Isomeric SMILES

CC[NH+](CC)CC1=NC(=C2C(=C(SC2=N1)C)C)OC3=CC(=CC(=C3)OC)OC

InChI

InChI=1S/C21H27N3O3S/c1-7-24(8-2)12-18-22-20(19-13(3)14(4)28-21(19)23-18)27-17-10-15(25-5)9-16(11-17)26-6/h9-11H,7-8,12H2,1-6H3/p+1